Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP9 | P14780 | 3/20 | 0.49 |
| ▸ | MMP2 | P08253 | 2/20 | 0.49 |
| ▸ | MMP1 | P03956 | 2/20 | 0.49 |
| ▸ | MMP3 | P08254 | 2/20 | 0.49 |
| ▸ | MMP7 | P09237 | 2/20 | 0.49 |
| ▸ | MMP8 | P22894 | 2/20 | 0.49 |
| ▸ | MMP13 | P45452 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | MMP12 | P39900 | 1/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2929201 | 0.88 | MMP9 (0.46) | MMP9MMP2MMP1MMP3MMP7 | |
| SCHEMBL2927569 | 0.85 | MMP9 (0.50) | MMP9MMP2MMP1MMP3MMP7 | |
| SCHEMBL2928560 | 0.84 | MMP9 (0.52) | MMP9MMP2MMP1MMP3MMP7 | |
| SCHEMBL2930771 | 0.79 | ALDH1A1 (0.43) | ALDH1A1GAAPKMPOLBTSHR | |
| SCHEMBL2924847 | 0.77 | MMP9 (0.62) | MMP9MMP2MMP1MMP3MMP7 | |
| SCHEMBL8271936 | 0.74 | MMP9 (0.57) | MMP9MMP2MMP1MMP3MMP7 | |
| SCHEMBL1655808 | 0.74 | MMP9 (0.57) | MMP9MMP2MMP1MMP3MMP7 | |
| SCHEMBL1658411 | 0.73 | MMP9 (0.45) | MMP9MMP2MMP1MMP3MMP7 | |
| SCHEMBL1655664 | 0.73 | MMP9 (0.73) | MMP9MMP2MMP1MMP3MMP7 | |
| SCHEMBL2927062 | 0.73 | MMP9 (0.51) | MMP9MMP2MMP1MMP3MMP7 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1768979-B1 | OCTAHYDROPYRROLO[2, 3, C]PYRIDINE DERIVATIVES AND PHARMACEUTICAL USE THEREOF | MERCK SERONO SA (CH) | 2010-09-29 | — | — | EP | claimed |